3-[2-(pyrimidin-2-ylamino)piperidin-1-yl]benzenecarbonitrile

Systemtic Name: 3-[2-(pyrimidin-2-ylamino)piperidin-1-yl]benzenecarbonitrile Openeye Name: 3-[2-(pyrimidin-2-ylamino)-1-piperidyl]benzonitrile CAS Name: 3-[2-(2-pyrimidinylamino)-1-piperidinyl]benzonitrile IUPAC Name: 3-[2-(pyrimidin-2-ylamino)piperidin-1-yl]benzonitrile Traditional Name: 3-[2-(2-pyrimidylamino)piperidino]benzonitrile Formula: C16H17N5 MolecularWeight: 279.33968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)NC2=NC=CC=N2)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCN(C(C1)NC2=NC=CC=N2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H17N5/c17-12-13-5-3-6-14(11-13)21-10-2-1-7-15(21)20-16-18-8-4-9-19-16/h3-6,8-9,11,15H,1-2,7,10H2,(H,18,19,20)